Structural and electronic properties of small beryllium clusters: A theoretical study

Journal of Chemical Physics

Volumn 121, Issue 15, 2004, Pages 7243-7252

  Srinivas, Sudha ^a   Jellinek, Julius ^b  

^a CENTRAL MICHIGAN UNIVERSITY   (United States)

^b ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

GEOMETRIC STRUCTURES; LOCAL SPIN-DENSITY APPROXIMATION (LSDA); QUINTET SPIN STATE; SPIN MULTIPLICITY;

APPROXIMATION THEORY; CHEMICAL BONDS; ELECTRONIC STRUCTURE; GENETIC ALGORITHMS; MATHEMATICAL MODELS; MELTING; MONTE CARLO METHODS; NATURAL FREQUENCIES; OPTIMIZATION; PERTURBATION TECHNIQUES; PROBABILITY DENSITY FUNCTION; THERMAL EFFECTS; THERMODYNAMIC STABILITY;

BERYLLIUM;

EID: 8344227716     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1791071     Document Type: Article

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